[2-[[3,5-dimethyl-2-(4-methylphenyl)sulfonyloxy-phenyl]-diphenyl-methyl]-4,6-dimethyl-phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-[[3,5-dimethyl-2-(4-methylphenyl)sulfonyloxy-phenyl]-diphenyl-methyl]-4,6-dimethyl-phenyl] 4-methylbenzenesulfonate Openeye Name: [2-[[3,5-dimethyl-2-(p-tolylsulfonyloxy)phenyl]-diphenyl-methyl]-4,6-dimethyl-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[[3,5-dimethyl-2-(4-methylphenyl)sulfonyloxyphenyl]-diphenylmethyl]-4,6-dimethylphenyl] ester IUPAC Name: [2-[[3,5-dimethyl-2-(4-methylphenyl)sulfonyloxyphenyl]-diphenylmethyl]-4,6-dimethylphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[(3,5-dimethyl-2-tosyloxy-phenyl)-diphenyl-methyl]-4,6-dimethyl-phenyl] ester Formula: C43H40O6S2 MolecularWeight: 716.9041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC(=CC(=C5OS(=O)(=O)C6=CC=C(C=C6)C)C)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC(=CC(=C5OS(=O)(=O)C6=CC=C(C=C6)C)C)C)C)C

InChI

InChI=1S/C43H40O6S2/c1-29-17-21-37(22-18-29)50(44,45)48-41-33(5)25-31(3)27-39(41)43(35-13-9-7-10-14-35,36-15-11-8-12-16-36)40-28-32(4)26-34(6)42(40)49-51(46,47)38-23-19-30(2)20-24-38/h7-28H,1-6H3